Ethyl furan-3-propionate
TL;DR: Ethyl furan-3-propionate (CAS 56859-91-7) is a chemical compound with molecular formula C9H12O3 and molecular weight 168.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 3-(furan-3-yl)propanoate
Also Known As: Ethyl furan-3-propionate, ethyl 3-(furan-3-yl)propanoate, ethylfuran-3-propionate, ethyl 3-(3-furyl)propanoate, Ethyl 3-(3-furanyl)propionate
| Molecular Formula | C9H12O3 |
|---|---|
| Molecular Weight | 168.08 g/mol |
| LogP | 1.4 |
| Topological Polar Surface Area | 39.4 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 5 |
| Exact Mass | 168.07864 |
| Heavy Atoms | 12 |
| Complexity | 145.0 |
Chemical Identifiers
| CAS Number | 56859-91-7 |
|---|---|
| SMILES | CCOC(=O)CCC1=COC=C1 |
| InChIKey | MGBZGBGWTZISIG-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Ethyl furan-3-propionate (CAS 56859-91-7), with molecular formula C9H12O3 and molecular weight 168.08 g/mol. IUPAC: ethyl 3-(furan-3-yl)propanoate.
Chemical Property Profile of Ethyl furan-3-propionate
Property Insights of Ethyl furan-3-propionate
The XLogP value of 1.4 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Ethyl furan-3-propionate. With a topological polar surface area (TPSA) of 39.4 Ų, Ethyl furan-3-propionate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Ethyl furan-3-propionate has 0 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Ethyl furan-3-propionate?
The CAS number of Ethyl furan-3-propionate is 56859-91-7.
What is the molecular formula of Ethyl furan-3-propionate?
The molecular formula of Ethyl furan-3-propionate is C9H12O3.
What is the molecular weight of Ethyl furan-3-propionate?
The molecular weight of Ethyl furan-3-propionate is 168.08 g/mol.
Where can I buy Ethyl furan-3-propionate?
You can request a quote for Ethyl furan-3-propionate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Ethyl furan-3-propionate?
Yes, KEHONG BIO provides custom synthesis services for Ethyl furan-3-propionate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.